1-(3-ethylcyclohexyl)-N-methylhex-5-en-1-amine

C15H29N — CID 65414544

IUPAC1-(3-ethylcyclohexyl)-N-methylhex-5-en-1-amine
SMILESC=CCCCC(NC)C1CCCC(CC)C1
InChIInChI=1S/C15H29N/c1-4-6-7-11-15(16-3)14-10-8-9-13(5-2)12-14/h4,13-16H,1,5-12H2,2-3H3
InChIKeyLFXXXNAUQFEIIC-UHFFFAOYSA-N
MW223.40 g/mol
LogP4.15
Rot. Bonds7

About 1-(3-ethylcyclohexyl)-N-methylhex-5-en-1-amine

1-(3-ethylcyclohexyl)-N-methylhex-5-en-1-amine (PubChem CID 65414544) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is 1-(3-ethylcyclohexyl)-N-methylhex-5-en-1-amine.

Molecular Properties

Compound Name1-(3-ethylcyclohexyl)-N-methylhex-5-en-1-amine
PubChem CID65414544
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC Name1-(3-ethylcyclohexyl)-N-methylhex-5-en-1-amine
SMILESC=CCCCC(NC)C1CCCC(CC)C1
InChIInChI=1S/C15H29N/c1-4-6-7-11-15(16-3)14-10-8-9-13(5-2)12-14/h4,13-16H,1,5-12H2,2-3H3
InChIKeyLFXXXNAUQFEIIC-UHFFFAOYSA-N
XLogP4.15
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.40
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-1-(3-ethylcyclohexyl)oct-7-en-1-amine
CID 107009239
1-(3-ethylcyclohexyl)hex-5-en-1-amine
CID 65413113
1-cyclohexyl-N-methyloct-7-en-1-amine
CID 107008890
1-(3-ethylcyclohexyl)-4-methoxy-N-methylpentan-1-amine
CID 105156121
1-(4-butylcyclohexyl)-N-methylhex-5-en-1-amine
CID 104986932
1-(3-ethylcyclopentyl)hex-5-en-1-amine
CID 65411985
1-(3-ethylcyclohexyl)-N-propan-2-ylpentan-1-amine
CID 79411539
N-methyl-1-(2-methylcyclopentyl)hex-5-en-1-amine
CID 107189131
1-(3-ethylcyclohexyl)-N-methylpent-3-yn-1-amine
CID 65415557
1-[3-(2-cycloheptylethyl)cyclohexyl]-N-methylbutan-1-amine
CID 170003941
N-ethyl-1-(3-ethylcyclohexyl)decan-1-amine
CID 65415153
1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)hex-5-enylhydrazine
CID 105311234

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethylcyclohexyl)-N-methylhex-5-en-1-amine?
The IUPAC name of 1-(3-ethylcyclohexyl)-N-methylhex-5-en-1-amine (CID 65414544) is 1-(3-ethylcyclohexyl)-N-methylhex-5-en-1-amine.
What is the SMILES notation for 1-(3-ethylcyclohexyl)-N-methylhex-5-en-1-amine?
The canonical SMILES for 1-(3-ethylcyclohexyl)-N-methylhex-5-en-1-amine is C=CCCCC(NC)C1CCCC(CC)C1.
What is the InChIKey of 1-(3-ethylcyclohexyl)-N-methylhex-5-en-1-amine?
The InChIKey is LFXXXNAUQFEIIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N/c1-4-6-7-11-15(16-3)14-10-8-9-13(5-2)12-14/h4,13-16H,1,5-12H2,2-3H3.
What are the key properties of 1-(3-ethylcyclohexyl)-N-methylhex-5-en-1-amine?
1-(3-ethylcyclohexyl)-N-methylhex-5-en-1-amine has a molecular weight of 223.40 g/mol, XLogP of 4.15, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethylcyclohexyl)-N-methylhex-5-en-1-amine is sourced from PubChem (CID 65414544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).